Machine learning – Page 8
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ResearchLigand selector steers C–N cross-couplings down most sustainable path
Tool is step towards strategy that considers reagents and reactants above and below the arrow
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ResearchMachine learning predicts ammunition from gunshot residue
Forensic tool will assist investigators by turning back time on firearm chemistry
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ResearchPatent-busting AI tool navigates around protected drug pathways
Organic retrosynthesis software can identify key bonds involved in patented reactions to find alternative pathways
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ResearchDispute over reaction prediction puts machine learning’s pitfalls in spotlight
Two research teams’ argument over a reaction-predicting algorithm show that there is still a lot to understand when applying machine learning to chemistry
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ReviewHello World: How to be Human in the Age of the Machine
Mathematician Hannah Fry explores the power and limitations of the algorithms that surround us
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ResearchMachine learning behind beta boron bonding breakthrough
Study resolves long-standing uncertainty over structure of boron
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ResearchAlgorithm decides on chemical compromises when optimising self-driving experiments
Greek mythology inspires machine-learning approach
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ResearchMachine learning makes light work of hard materials
Algorithm successfully identifies superhard compounds, eliminating the need for lengthy trial and error
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ResearchAI tool could save on animal tests
Algorithm could also help unravel poisoning or environmental contamination cases
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ResearchAI robot tests, predicts and even discovers reactions that are new to chemistry
Robotic chemist finds four unknown reactions and could speed up the discovery of new chemistry
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ResearchMachine learning masters molecules
Deep learning algorithms set to transform time-consuming molecular screening programs
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OpinionWill robots make you redundant?
Smart machines could soon outpace even the best organic chemist
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ResearchMachine learning triumphs in tough cross coupling challenge
5000 nanoscale experiments teach algorithm how to predict outcomes of reactions in the presence of inhibitors
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ResearchRobot with AI brain learns to evolve synthetic protocells
Evolution of oil-in-water system guided by machine learning offers insight into origins of life
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ReviewThe digital mind: how science is redefining humanity
What will be the consequences for society when brains and computers become indistinguishable?
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ResearchBenchmark for molecular machine learning
Scientists make open-source database to test programs that learn chemistry
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ReviewCommon sense, the Turing test, and the quest for real AI
To produce thinking machines – or even just machines that we think are thinking – we first need to understand exactly how we think.
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ResearchSmall data unpicks complex interactions
Machine learning models complex physical systems with sparse datasets